2-amino-4-{5-[(4-fluorophenoxy)methyl]-2,4-dimethylphenyl}-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-{5-[(4-fluorophenoxy)methyl]-2,4-dimethylphenyl}-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
2-amino-4-{5-[(4-fluorophenoxy)methyl]-2,4-dimethylphenyl}-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8015-4948 |
| Compound Name: | 2-amino-4-{5-[(4-fluorophenoxy)methyl]-2,4-dimethylphenyl}-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C26 H26 F N3 O |
| Smiles: | Cc1cc(C)c(cc1COc1ccc(cc1)F)c1c2CCCCCc2nc(c1C#N)N |
| Stereo: | ACHIRAL |
| logP: | 6.1594 |
| logD: | 6.1582 |
| logSw: | -5.6042 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.315 |
| InChI Key: | GCUPQDTXBJPKDN-UHFFFAOYSA-N |